SCHEMBL9534476

SCHEMBL9534476

CCCCCCCCCCCCc1ccoc1C(SCCC(=O)O)C(O)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 19/20 0.53
CYSLTR1 Q9Y271 19/20 0.53

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL9538018 0.88 CYSLTR2 (0.69) CYSLTR2CYSLTR1
SCHEMBL9532917 0.82 CYSLTR2 (0.53) CYSLTR2CYSLTR1
SCHEMBL27262084 0.80 CYSLTR2 (0.81) CYSLTR2CYSLTR1
SCHEMBL9395589 0.80 CYSLTR2 (0.81) CYSLTR2CYSLTR1
SCHEMBL9395596 0.80 CYSLTR2 (0.81) CYSLTR2CYSLTR1
SCHEMBL9535168 0.78 CYSLTR2 (0.53) CYSLTR2CYSLTR1
SCHEMBL9484665 0.77 CYSLTR2 (0.69) CYSLTR2CYSLTR1
SCHEMBL9484672 0.75 CYSLTR2 (0.58) CYSLTR2CYSLTR1
SCHEMBL9533721 0.73 CYSLTR2 (0.44) CYSLTR2CYSLTR1
SCHEMBL9560022 0.71 CYSLTR2 (0.69) CYSLTR2CYSLTR1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0528957-A4 FIVE-MEMBERED RING ALKANOIC ACID LEUKOTRIENE ANTAGONISTS 1993-05-05 EP disclosed
EP-0528957-A1 FIVE-MEMBERED RING ALKANOIC ACID LEUKOTRIENE ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1993-03-03 EP disclosed
WO-1991016889-A1 FIVE-MEMBERED RING ALKANOIC ACID LEUKOTRIENE ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1991-11-14 WO disclosed